1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one

C24H32N2O2 — CID 155754250

IUPAC1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one
SMILESCCN(CCCc1ccccc1)C(C(C)=O)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C24H32N2O2/c1-3-25(15-7-10-21-8-5-4-6-9-21)24(20(2)27)22-11-13-23(14-12-22)26-16-18-28-19-17-26/h4-6,8-9,11-14,24H,3,7,10,15-19H2,1-2H3
InChIKeyQOCIZJANHPFUFR-UHFFFAOYSA-N
MW380.53 g/mol
LogP4.11
Rot. Bonds9

About 1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one

1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one (PubChem CID 155754250) has the molecular formula C24H32N2O2 and a molecular weight of 380.53 g/mol. Its IUPAC name is 1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one.

Molecular Properties

Compound Name1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one
PubChem CID155754250
Molecular FormulaC24H32N2O2
Molecular Weight380.53 g/mol
Exact Mass380.25
IUPAC Name1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one
SMILESCCN(CCCc1ccccc1)C(C(C)=O)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C24H32N2O2/c1-3-25(15-7-10-21-8-5-4-6-9-21)24(20(2)27)22-11-13-23(14-12-22)26-16-18-28-19-17-26/h4-6,8-9,11-14,24H,3,7,10,15-19H2,1-2H3
InChIKeyQOCIZJANHPFUFR-UHFFFAOYSA-N
XLogP4.11
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.53
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}

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Related Compounds

2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one
CID 57110605
2-[(4-morpholin-4-ylbenzoyl)-(2-phenylethyl)amino]acetic acid
CID 119347604
N-(2-morpholin-4-yl-2-oxoethyl)-N-(3-phenylpropyl)acetamide
CID 113165782
2,6-bis(dimethylamino)-3,5-bis(4-morpholin-4-ylphenyl)-1,7-diphenylheptan-4-one
CID 175073819
N,N-dimethyl-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-2-amine
CID 69032943
3-[ethyl(3-phenylpropyl)amino]butanoic acid
CID 62826742
2-ethyl-3-(4-morpholin-4-ylphenyl)-1,4-diphenylbutan-1-one
CID 175266354
4-[4-(1-phenylpentan-2-yl)phenyl]morpholine
CID 174948400
N-ethyl-N-[(3-morpholin-4-ylphenyl)methyl]acetamide
CID 144965173
N-[2-(diethylamino)propyl]-2-(4-morpholin-4-ylphenyl)acetamide
CID 110620370
2-(dimethylamino)-4-(4-morpholin-4-ylphenyl)-5-phenylpentanal
CID 87659120
N-ethyl-N-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]-2-(2-phenylethyl)benzamide
CID 55342172

Frequently Asked Questions

What is the IUPAC name of 1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one?
The IUPAC name of 1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one (CID 155754250) is 1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one.
What is the SMILES notation for 1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one?
The canonical SMILES for 1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one is CCN(CCCc1ccccc1)C(C(C)=O)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of 1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one?
The InChIKey is QOCIZJANHPFUFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O2/c1-3-25(15-7-10-21-8-5-4-6-9-21)24(20(2)27)22-11-13-23(14-12-22)26-16-18-28-19-17-26/h4-6,8-9,11-14,24H,3,7,10,15-19H2,1-2H3.
What are the key properties of 1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one?
1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one has a molecular weight of 380.53 g/mol, XLogP of 4.11, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[ethyl(3-phenylpropyl)amino]-1-(4-morpholin-4-ylphenyl)propan-2-one is sourced from PubChem (CID 155754250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).